In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 13 | Yes |
Popular Name: (2S)-N2-ethyl-N1-(1-ethylpropyl)-N1-methyl-propane-1,2-diamine (2S)-N2-ethyl-N1-(1-ethylpropyl)…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.58 | 6.64 | -105.2 | 3 | 2 | 2 | 21 | 188.359 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.58 | 5.37 | -29.89 | 2 | 2 | 1 | 16 | 187.351 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.58 | 5.29 | -30.69 | 2 | 2 | 1 | 20 | 187.351 | 7 | ↓ |